SCHEMBL6482502

SCHEMBL6482502

C[C@H]1NC(=O)C[C@@H]1c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.45
SLC6A2 P23975 4/20 0.45
SLC6A4 P31645 1/20 0.45
ALDH1A1 P00352 1/20 0.44
FPR1 P21462 6/20 0.42
FPR2 P25090 5/20 0.42
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
CHRNA7 P36544 1/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6482507 1.00 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4ALDH1A1FPR1
SCHEMBL6482499 1.00 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4ALDH1A1FPR1
SCHEMBL18590502 0.84 MAPT (0.42) ALDH1A1LMNA
SCHEMBL18590503 0.84 MAPT (0.42) ALDH1A1LMNA
SCHEMBL18590508 0.84 MAPT (0.42) ALDH1A1LMNA
SCHEMBL18590507 0.84 MAPT (0.42) ALDH1A1LMNA
SCHEMBL15927585 0.82 ALDH1A1 (0.33) SLC6A3ALDH1A1TP53MDM2
SCHEMBL12525034 0.81 ALDH1A1 (0.48) ALDH1A1LMNAGAA
SCHEMBL1904591 0.81 ALDH1A1 (0.48) ALDH1A1LMNAGAA
SCHEMBL1901694 0.81 ALDH1A1 (0.48) ALDH1A1LMNAGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032858-A1 Novel heterocyclic compound and anti-inflamatory agent NIPPON SODA CO., LTD. (JP) 2005-02-10 US disclosed
EP-1435353-A1 NOVEL HETEROCYCLIC COMPOUND AND ANTI-INFLAMMATORY AGENT NIPPON SODA CO., LTD. (JP) 2004-07-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050032858-A1 Novel heterocyclic compound and anti-inflamatory agent TLR5, IRF3, IL4 SLC6A3 4753/4885SLC6A2 4738/4885SLC6A4 4147/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.